Mol:FL4DF8NS0003

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FL4DF8NS0003.png

 
 
Copyright: ARM project http://www.metabolome.jp/ 
 27 29  0  0  0  0  0  0  0  0999 V2000 
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    2.3470    2.0581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.6341    1.6428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    0.2756   -1.4469    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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    1.8125   -0.8206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    2.5270   -2.0581    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
    1.8125   -1.6456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    1.0980   -2.0581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
   -3.0662    0.4203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
    2.3533   -0.2788    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0 
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   -1.8423    1.9485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0 
  1  2  2  0  0  0  0 
  1  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  2  1  0  0  0  0 
  5  7  1  0  0  0  0 
  7  8  1  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  1  0  0  0  0 
 10  6  1  0  0  0  0 
  9 11  1  6  0  0  0 
 11 12  2  0  0  0  0 
 12 13  1  0  0  0  0 
 13 14  2  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 16 11  1  0  0  0  0 
  7 17  2  0  0  0  0 
  4 18  1  0  0  0  0 
  8 20  1  1  0  0  0 
  1 19  1  0  0  0  0 
 20 22  1  0  0  0  0 
 21 22  2  0  0  0  0 
 22 23  1  0  0  0  0 
 19 24  1  0  0  0  0 
 12 25  1  0  0  0  0 
  2 26  1  0  0  0  0 
 26 27  1  0  0  0  0 
S  SKP  8 
ID	FL4DF8NS0003 
KNApSAcK_ID	C00014377 
NAME	(2R,3R)-5,2'-Dihydroxy-7,8-dimethoxy-3-O-acetylflavanone 
CAS_RN	364367-60-2 
FORMULA	C19H18O8 
EXACTMASS	374.100167552 
AVERAGEMASS	374.34142 
SMILES	c(c1OC)(OC)cc(c(C2=O)c(OC(c(c3)c(O)ccc3)C2OC(C)=O)1)O 
M  END
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